3-ethyl-1-fluoropentan-3-ol

C7H15FO — CID 174533406

IUPAC3-ethyl-1-fluoropentan-3-ol
SMILESCCC(O)(CC)CCF
InChIInChI=1S/C7H15FO/c1-3-7(9,4-2)5-6-8/h9H,3-6H2,1-2H3
InChIKeyQSFOCYJSJKVVGN-UHFFFAOYSA-N
MW134.19 g/mol
LogP1.90
Rot. Bonds4

About 3-ethyl-1-fluoropentan-3-ol

3-ethyl-1-fluoropentan-3-ol (PubChem CID 174533406) has the molecular formula C7H15FO and a molecular weight of 134.19 g/mol. Its IUPAC name is 3-ethyl-1-fluoropentan-3-ol.

Molecular Properties

Compound Name3-ethyl-1-fluoropentan-3-ol
PubChem CID174533406
Molecular FormulaC7H15FO
Molecular Weight134.19 g/mol
Exact Mass134.11
IUPAC Name3-ethyl-1-fluoropentan-3-ol
SMILESCCC(O)(CC)CCF
InChIInChI=1S/C7H15FO/c1-3-7(9,4-2)5-6-8/h9H,3-6H2,1-2H3
InChIKeyQSFOCYJSJKVVGN-UHFFFAOYSA-N
XLogP1.90
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.19
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-methyl-3-Pentanol
CID 6493
3-Ethyl-3-pentanol
CID 11702
4-Fluoro-2-methylpentan-2-ol
CID 19083207
4-Fluoro-2-methylbutan-2-ol
CID 84647630
3-Fluoro-2-methylpentan-2-ol
CID 22000515
3-(Trifluoromethyl)pentan-3-ol
CID 14249275
3-(Difluoromethyl)pentan-3-ol
CID 15783626
1-Fluoro-2-methylpentan-2-ol
CID 19752039
3-Fluoro-2,3-dimethylbutan-2-ol
CID 22000462
5-Fluoro-2-methylpentan-2-ol
CID 22000481
3-Fluoro-2-methylbutan-2-ol
CID 22000493
1,1,1-Trifluoro-3-methylpentan-3-ol
CID 59898442

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-fluoropentan-3-ol?
The IUPAC name of 3-ethyl-1-fluoropentan-3-ol (CID 174533406) is 3-ethyl-1-fluoropentan-3-ol.
What is the SMILES notation for 3-ethyl-1-fluoropentan-3-ol?
The canonical SMILES for 3-ethyl-1-fluoropentan-3-ol is CCC(O)(CC)CCF.
What is the InChIKey of 3-ethyl-1-fluoropentan-3-ol?
The InChIKey is QSFOCYJSJKVVGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15FO/c1-3-7(9,4-2)5-6-8/h9H,3-6H2,1-2H3.
What are the key properties of 3-ethyl-1-fluoropentan-3-ol?
3-ethyl-1-fluoropentan-3-ol has a molecular weight of 134.19 g/mol, XLogP of 1.90, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-fluoropentan-3-ol is sourced from PubChem (CID 174533406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).